ethanedioate; N-[2-(3-methyl-1,3-diazinan-1-yl)ethyl]aniline

Systemtic Name: ethanedioate; N-[2-(3-methyl-1,3-diazinan-1-yl)ethyl]aniline Openeye Name: N-[2-(3-methylhexahydropyrimidin-1-yl)ethyl]aniline; oxalate CAS Name: N-[2-(3-methyl-1,3-diazinan-1-yl)ethyl]aniline; oxalate IUPAC Name: N-[2-(3-methyl-1,3-diazinan-1-yl)ethyl]aniline; oxalate Traditional Name: 2-(3-methylhexahydropyrimidin-1-yl)ethyl-phenyl-amine; oxalate Formula: C17H21N3O8-4 MolecularWeight: 395.36394

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(C1)CCNC2=CC=CC=C2.C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CN1CCCN(C1)CCNC2=CC=CC=C2.C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C13H21N3.2C2H2O4/c1-15-9-5-10-16(12-15)11-8-14-13-6-3-2-4-7-13;2*3-1(4)2(5)6/h2-4,6-7,14H,5,8-12H2,1H3;2*(H,3,4)(H,5,6)/p-4